5,7,12-Trioxa-6-stannaoctacosa-2,9-dienoic acid, 6,6-dibutyl-4,8,11-trioxo-, hexadecyl ester
Basic information
- CAS
84787-79-1- Standard SMILES
CCCCCCCCCCCCCCCCOC(=O)C=CC(=O)[O][Sn]([CH2]CCC)([CH2]CCC)[O]C(=O)C=CC(=O)OCCCCCCCCCCCCCCCC- InChIKey
WKBGYBQIHPLBDZ-UHFFFAOYSA-L- Molecular formula
- C48H88O8Sn
- Average molar mass
- 911.9 g/mol
- Monoisotopic mass
- 912.550122
Names & identifiers
- Preferred name
- 5,7,12-Trioxa-6-stannaoctacosa-2,9-dienoic acid, 6,6-dibutyl-4,8,11-trioxo-, hexadecyl ester
- IUPAC
- 4-O-[dibutyl-(4-hexadecoxy-4-oxobut-2-enoyl)oxystannyl] 1-O-hexadecyl but-2-enedioate
Names & synonyms
DTXSID8011199395,7,12-Trioxa-6-stannaoctacosa-2,9-dienoic acid, 6,6-dibutyl-4,8,11-trioxo-, hexadecyl esterNS00061193Hexadecyl 6,6-dibutyl-4,8,11-trioxo-5,7,12-trioxa-6-stannaoctacosa-2,9-dien-1-oate
Database identifiers
- CAS
84787-79-1- PubChem CID
- 53436616
- DTXSID
DTXSID801119939
Properties
Computed structural properties
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 46
- Heavy atoms
- 57
- Formal charge
- 0
- Complexity
- 946
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…